4-[5-chloranyl-2-[phenylsulfonyl(propan-2-yl)amino]phenoxy]benzoic acid

Systemtic Name: 4-[5-chloranyl-2-[phenylsulfonyl(propan-2-yl)amino]phenoxy]benzoic acid Openeye Name: 4-[2-[benzenesulfonyl(isopropyl)amino]-5-chloro-phenoxy]benzoic acid CAS Name: 4-[2-[benzenesulfonyl(propan-2-yl)amino]-5-chlorophenoxy]benzoic acid IUPAC Name: 4-[2-[benzenesulfonyl(propan-2-yl)amino]-5-chlorophenoxy]benzoic acid Traditional Name: 4-[2-[besyl(isopropyl)amino]-5-chloro-phenoxy]benzoic acid Formula: C22H20ClNO5S MolecularWeight: 445.9159

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N(C1=C(C=C(C=C1)Cl)OC2=CC=C(C=C2)C(=O)O)S(=O)(=O)C3=CC=CC=C3

Isomeric SMILES

CC(C)N(C1=C(C=C(C=C1)Cl)OC2=CC=C(C=C2)C(=O)O)S(=O)(=O)C3=CC=CC=C3

InChI

InChI=1S/C22H20ClNO5S/c1-15(2)24(30(27,28)19-6-4-3-5-7-19)20-13-10-17(23)14-21(20)29-18-11-8-16(9-12-18)22(25)26/h3-15H,1-2H3,(H,25,26)